# generated using pymatgen data_Hf6Al16FeNi6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.42884901 _cell_length_b 8.42884839 _cell_length_c 8.42884924 _cell_angle_alpha 60.00000434 _cell_angle_beta 60.00000680 _cell_angle_gamma 59.99999986 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6Al16FeNi6 _chemical_formula_sum 'Hf6 Al16 Fe1 Ni6' _cell_volume 423.43801041 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Hf Hf0 1 0.68971027 0.68971027 0.31028973 1.0 Hf Hf1 1 0.31028973 0.68971027 0.31028973 1.0 Hf Hf2 1 0.68971027 0.31028973 0.31028973 1.0 Hf Hf3 1 0.31028973 0.31028973 0.68971027 1.0 Hf Hf4 1 0.68971027 0.31028973 0.68971027 1.0 Hf Hf5 1 0.31028973 0.68971027 0.68971027 1.0 Al Al6 1 0.88257341 0.88257341 0.35227877 1.0 Al Al7 1 0.88257341 0.35227877 0.88257341 1.0 Al Al8 1 0.35227877 0.88257341 0.88257341 1.0 Al Al9 1 0.88257341 0.88257341 0.88257341 1.0 Al Al10 1 0.11742659 0.11742659 0.64772123 1.0 Al Al11 1 0.11742659 0.64772123 0.11742659 1.0 Al Al12 1 0.64772123 0.11742659 0.11742659 1.0 Al Al13 1 0.11742659 0.11742659 0.11742659 1.0 Al Al14 1 0.66646197 0.66646197 0.00061408 1.0 Al Al15 1 0.66646197 0.00061408 0.66646197 1.0 Al Al16 1 0.00061408 0.66646197 0.66646197 1.0 Al Al17 1 0.66646197 0.66646197 0.66646197 1.0 Al Al18 1 0.33353803 0.33353803 0.99938592 1.0 Al Al19 1 0.33353803 0.99938592 0.33353803 1.0 Al Al20 1 0.99938592 0.33353803 0.33353803 1.0 Al Al21 1 0.33353803 0.33353803 0.33353803 1.0 Fe Fe22 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni23 1 0.00000000 0.00000000 0.50000000 1.0 Ni Ni24 1 0.50000000 0.00000000 0.50000000 1.0 Ni Ni25 1 0.00000000 0.50000000 0.50000000 1.0 Ni Ni26 1 0.50000000 0.50000000 0.00000000 1.0 Ni Ni27 1 0.00000000 0.50000000 0.00000000 1.0 Ni Ni28 1 0.50000000 0.00000000 0.00000000 1.0